Numerical Simulation of Making Hydrogen from Rich Filtration Combustion of Hydrogen Sulfide

Li Guoneng
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Abstract

Filtration combustion in porous media offers good advantages such as super-adiabatic combustion temperature in making hydrogen from hydrogen sulfur which is extremely toxic and is vastly produced in industry. In order to study the mechanism of making hydrogen from rich filtration combustion of hydrogen sulfur, computational fluid dynamics (CFD) were employed combining with a detail H2S oxidation mechanism to model the filtration combustion of hydrogen sulfide in a packed bed of uniform 3 mm diameter alumina spherical particles. The standard k-e turbulence model and a detail H2S oxidation mechanism with 17 species and 57 elemental reactions were adopted, and several equivalence ratios phi (1.0-4.0) were investigated. The numerical results agreed well with the experimental data, indicating that the combination of CFD with detail chemical kinetics gives good performance in modeling the anisotropic filtration flames. The combustion temperature exceeds the theoretical adiabatic combustion temperature by over 300 K, offering high temperature to decompose the hydrogen sulfide to hydrogen up to a conversion rate of 20%. On the other hand, the simulated combustion temperatures were relatively lower than the experimental data, resulting that much more un-burnt H2S (3.6% in simulation and 2.2% in experiment when phi=2.0) existed at the outlet. However, the predicted hydrogen concentrations were larger (3.3% in simulation and 2.0% in experimental when phi=2.0) than those measured in experiment.
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硫化氢富过滤燃烧制氢的数值模拟
多孔介质中的过滤燃烧具有超绝热燃烧温度等优点,可将工业上大量生产的剧毒硫氢转化为氢。为了研究硫化氢富过滤燃烧制氢机理,采用计算流体力学(CFD)方法,结合硫化氢氧化机理,对硫化氢在直径均匀的3mm氧化铝球形颗粒填充床内的过滤燃烧进行了模拟。采用标准k-e湍流模型和17种57个单质反应的H2S氧化机理,考察了几个等效比phi(1.0-4.0)。数值计算结果与实验数据吻合较好,表明CFD与精细化学动力学相结合的方法能够较好地模拟各向异性过滤火焰。燃烧温度比理论绝热燃烧温度高出300 K以上,为硫化氢分解为氢提供了高达20%转化率的高温。另一方面,模拟燃烧温度相对低于实验数据,导致出口存在更多未燃烧的H2S(模拟为3.6%,实验为2.2%,当phi=2.0时)。然而,当phi=2.0时,预测的氢浓度比实验测量值大(模拟值为3.3%,实验值为2.0%)。
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